Information card for entry 7057125

Structure parameters

• Formula: C28 H36 Bi2 I10 N4
• Calculated formula: C28 H36 Bi2 I10 N4
• Title of publication: Black hybrid iodobismuthate containing linear anionic chains
• Authors of publication: Kotov, Vitalii Yu.; Ilyukhin, Andrey B.; Korlyukov, Alexander A.; Smol’yakov, Alexander F.; Kozyukhin, Sergey A.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 8
• Pages of publication: 6354
• a: 12.6544 ± 0.0016 Å
• b: 12.2914 ± 0.0015 Å
• c: 15.3829 ± 0.0019 Å
• α: 90°
• β: 92.656 ± 0.004°
• γ: 90°
• Cell volume: 2390.1 ± 0.5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0455
• Residual factor for significantly intense reflections: 0.0297
• Weighted residual factors for significantly intense reflections: 0.0652
• Weighted residual factors for all reflections included in the refinement: 0.0714
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No